SCHEMBL1059693

SCHEMBL1059693

Cn1c(Cc2nc3ccccc3n2C)nc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.64
NPC1 O15118 7/20 0.64
SMN1; SMN2 Q16637 5/20 0.64
LMNA P02545 2/20 0.64
KDM4E B2RXH2 1/20 0.62
POLB P06746 1/20 0.62
PKM P14618 2/20 0.60
MAPT P10636 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
PDE10A Q9Y233 2/20 0.58
GAA P10253 1/20 0.58
CYP2D6 P10635 1/20 0.58
USP2 O75604 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2518498 0.89 LMNA (0.63) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL30037937 0.86 RAB9A (0.62) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL757031 0.86 RAB9A (0.62) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL1374759 0.85 NPC1 (0.71) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL243922 0.84 LMNA (0.61) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL285358 0.84 RAB9A (0.60) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL2929122 0.84 MAPT (0.66) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL14050118 0.84 MAPT (0.76) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL103809 0.84 RAB9A (0.60) RAB9ANPC1SMN1; SMN2LMNAKDM4E
SCHEMBL104281 0.84 HDAC6 (0.61) RAB9ANPC1SMN1; SMN2LMNAKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2527404-B1 COMPOSITION FOR ULTRAVIOLET RAY-ABSORBABLE MEMBER, AND ULTRAVIOLET RAY-ABSORBABLE MEMBER COMPRISING SAME SUMITOMO SEIKA CHEMICALS (JP) 2019-05-29 EP disclosed
US-8680274-B2 Bent allenes, and their metal complexes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-03-25 US disclosed
US-8540904-B2 Composition for ultraviolet absorbent substance and ultraviolet absorbent substance comprising same SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2013-09-24 US disclosed
US-20120313058-A1 COMPOSITION FOR ULTRAVIOLET ABSORBENT SUBSTANCE AND ULTRAVIOLET ABSORBENT SUBSTANCE COMPRISING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2012-12-13 US disclosed
US-20110021775-A1 BENT ALLENES, AND THEIR METAL COMPLEXES NATIONAL SCIENCE FOUNDATION 2011-01-27 US disclosed
WO-2009089483-A1 BENT ALLENES, AND THEIR METAL COMPLEXES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-07-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110021775-A1 BENT ALLENES, AND THEIR METAL COMPLEXES NBAS, AP1M1, SOD1 RAB9A 1957/4885NPC1 1010/4885SMN1; SMN2 1618/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.